0 mol 11 unq 0 iso 0 dist 6.49709 7.4835 5.95165 4.4067 8.68293 10.5071 6.20956 4.73237 9.76946 6.09937 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 6.49709 7.4835 5.95165 13.2938 6.84216 9.80646 9.42607 5.8961 10.8687 9.07476 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 9.96446 5.27016 8.4545 12.0126 5.42067 8.46944 10.868 4.73713 9.59503 5.04673 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 6.70686 5.27016 7.01176 12.0126 7.36435 8.46944 10.868 4.36394 9.59503 5.04673 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 5.06555 8.75149 7.04864 8.14689 6.42623 4.74539 10.792 5.89379 8.43293 9.16089 numMergedOcc 0
5 mol 122 unq 0 iso 0 dist 8.47907 5.08302 9.40018 12.1473 4.42563 12.9961 8.3907 4.42285 11.3932 6.80798 numMergedOcc 0
6 mol 122 unq 1 iso 0 dist 8.47907 11.2519 6.78949 12.1473 4.42563 6.80573 8.3907 4.42285 10.8894 6.80798 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 6.44195 5.32921 9.93555 5.71332 8.89394 3.47453 9.71025 5.88662 10.6788 8.26128 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 7.75045 4.49316 9.63873 10.9436 8.16252 13.5948 9.04436 4.12904 9.04757 9.37245 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 6.53913 4.88159 5.59806 5.60897 5.36671 5.09728 12.5546 6.32863 10.5186 8.95296 numMergedOcc 0
10 mol 167 unq 1 iso 0 dist 6.53913 4.88159 5.59806 5.60897 5.36671 5.09728 9.08229 5.48405 9.763 6.10021 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 6.09874 14.0799 9.58911 14.1844 9.70481 3.55808 13.9024 8.58814 5.75545 8.17301 numMergedOcc 0
12 mol 196 unq 0 iso 0 dist 9.23836 13.7266 6.25429 6.17727 4.67869 7.96489 11.1899 4.57882 7.556 6.10505 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 7.94344 5.58634 4.84709 10.313 9.06459 6.62122 10.3357 5.67031 8.80167 9.68612 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 7.8128 12.3178 9.11256 9.83176 8.08965 3.76405 11.9334 5.23741 8.92054 8.1174 numMergedOcc 0
15 mol 235 unq 1 iso 0 dist 7.8128 4.27313 7.08539 9.83176 8.08965 12.0808 11.9334 5.23741 12.1257 8.1174 numMergedOcc 0
